Basic information
- CAS
102395-67-5- Standard SMILES
CN1CCC(C(=O)OC(c2ccccc2)c2ccccc2)CC1- InChIKey
GXGDVGOXIUXQPR-UHFFFAOYSA-N- Molecular formula
- C20H23NO2
- Average molar mass
- 309.4 g/mol
- Monoisotopic mass
- 309.17287898
Names & identifiers
- Preferred name
- Isonipecotic acid, 1-methyl-, diphenylmethyl ester
- IUPAC
- benzhydryl 1-methylpiperidine-4-carboxylate
- English name
- benzhydryl 1-methylpiperidine-4-carboxylate
- Molecular formula
- C20H23NO2
- Molecular weight
- 0
Names & synonyms
102395-67-5Diphenylmethyl 1-methylisonipecotateISONIPECOTIC ACID, 1-METHYL-, DIPHENYLMETHYL ESTERDTXSID10145017RefChem:349737DTXCID5067508benzhydryl 1-methylpiperidine-4-carboxylatediphenylmethyl 1-methylpiperidine-4-carboxylate4-Piperidinecarboxylic acid, 1-methyl-, diphenylmethyl ester
Database identifiers
- CAS
102395-67-5- PubChem CID
- 59331
- DTXSID
DTXSID10145017- Nikkaji
- J86.364E
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 346
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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